5,6beta-epoxy-5alpha-cholestan-3beta-ol (Q27103651)

5,6beta-epoxy-5alpha-cholestan-3beta-ol (English)

5 October 2016

stereoisomer of

cholesterol α-epoxide

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

cholesterol β-epoxide

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₇H₄₆O₂

1 reference

5,6beta-epoxy-5alpha-cholestan-3beta-ol (English)

5 October 2016

canonical SMILES

CC(C)CCCC(C)C1CCC2C1(CCC3C2CC4C5(C3(CCC(C5)O)C)O4)C

1 reference

5,6beta-epoxy-5alpha-cholestan-3beta-ol (English)

5 October 2016

isomeric SMILES

C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@@H]4[C@@]5([C@@]3(CC[C@@H](C5)O)C)O4)C

1 reference

5,6beta-epoxy-5alpha-cholestan-3beta-ol (English)

InChI=1S/C27H46O2/c1-17(2)7-6-8-18(3)21-9-10-22-20-15-24-27(29-24)16-19(28)11-14-26(27,5)23(20)12-13-25(21,22)4/h17-24,28H,6-16H2,1-5H3/t18-,19+,20+,21-,22+,23+,24-,25-,26-,27+/m1/s1

5 October 2016

Identifiers

InChI

1 reference

5,6beta-epoxy-5alpha-cholestan-3beta-ol (English)

PRYIJAGAEJZDBO-RUXQDQFYSA-N

5 October 2016

InChIKey

2 references

5,6beta-epoxy-5alpha-cholestan-3beta-ol (English)

CAS (formerly Chemical Abstracts Service)

5 October 2016

stated in

ChEBI release 2020-09-01

CAS Registry Number

114246-94-5

1 reference

stated in

25 January 2022

1 reference

(3beta,5alpha,6beta)-5,6-Epoxycholestan-3-ol (English)

5 October 2016

1 reference

5,6beta-epoxy-5alpha-cholestan-3beta-ol (English)

5 October 2016

ChEBI ID

28344

mapping relation type

2 references

5,6beta-epoxy-5alpha-cholestan-3beta-ol (English)